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2D Material Properties

Midwest Nano Infrastructure Corridor

HfSe3 – Hafnium triselenide – Transition Metal Trichalcogenide (TMT)

Crystal Structure

HfSe3 Crystal Structure
HfSe3 Crystal Structure
a1 5.40 Å
a2 3.71 Å
d1 2.69 Å
d2 2.74 Å
d3 2.74 Å
d4 2.85 Å

Bandstructure

HfSe3 Brillouin Zone
HfSe3 Brillouin Zone
HfSe3 Band Plot (HSE)
HfSe3 Band Plot (HSE)
PBEHSE
Valence Band Maximum -4.34 eV-4.30 eV
Conduction Band Minimum -4.01 eV-3.32 eV
Band Gap 0.33 eV0.98 eV